SCHEMBL17894094

SCHEMBL17894094

C1=Cc2cc3ccc(cc4nc(cc5ccc(cc1n2)[nH]5)C=C4)[nH]3.O=C(O)c1ccc(-c2c3nc(c(-c4ccc(C(=O)O)cc4)c4ccc([nH]4)c(-c4ccc(C(=O)O)cc4)c4nc(c(-c5ccc(C(=O)O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.75

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 4/20 0.75
▸ CYCS P99999 4/20 0.73
▸ STAT3 P40763 1/20 0.55
▸ STAT1 P42224 1/20 0.55
▸ ENPP2 Q13822 1/20 0.47
▸ ABCG2 Q9UNQ0 1/20 0.44
▸ TERT O14746 3/20 0.41
▸ MMP2 P08253 1/20 0.39
▸ MMP9 P14780 1/20 0.39
▸ MMP8 P22894 1/20 0.39
▸ MMP13 P45452 1/20 0.39
▸ GRIK1 P39086 1/20 0.39
▸ GRIK2 Q13002 1/20 0.39
▸ GRIK3 Q13003 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL140681 0.95 TOP1 (0.67) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL11339474 0.95 TOP1 (0.75) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL28919688 0.94 TOP1 (0.65) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL11334086 0.94 TOP1 (0.65) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL22332272 0.92 TOP1 (0.70) TOP1CYCSSTAT3STAT1ENPP2
SCHEMBL29354037 0.87 TOP1 (1.00) TOP1CYCSENPP2ABCG2TERT
SCHEMBL709532 0.87 TOP1 (1.00) TOP1CYCSENPP2ABCG2TERT
SCHEMBL3047596 0.85 TOP1 (0.97) TOP1CYCSENPP2ABCG2TERT
SCHEMBL19640853 0.85 CYCS (1.00) TOP1CYCSENPP2ABCG2TERT
SCHEMBL1497141 0.85 TOP1 (0.97) TOP1CYCSENPP2ABCG2TERT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10111842-B2 Eutectic solvents and uses thereof UNIVERSITY OF OSLO (NO) 2018-10-30 — — US claimed
US-20180000753-A1 EUTECTIC SOLVENTS AND USES THEREOF UNIVERSITY OF OSLO (NO) 2018-01-04 — — US claimed
WO-2016108083-A1 EUTECTIC SOLVENTS AND USES THEREOF UNIVERSITY OF OSLO (NO) 2016-07-07 — — WO claimed
US-20230302144-A1 Porphyrin Compounds and Compositions Useful for Treating Cancer ONCOSELECT THERAPEUTICS, LLC (US) 2023-09-28 — — US disclosed
US-11590233-B2 Porphyrin compounds and compositions useful for treating cancer ONCOSELECT THERAPEUTICS, LLC (US) 2023-02-28 — — US disclosed
US-20190184021-A1 Porphyrin Compounds and Compositions Useful for Treating Cancer ONCOSELECT THERAPEUTICS, LLC 2019-06-20 — — US disclosed
EP-3471774-A1 PORPHYRIN COMPOUNDS AND COMPOSITIONS USEFUL FOR TREATING CANCER Oncoselect Therapeutics, LLC (US) 2019-04-24 — — EP disclosed
US-10111842-B2 Eutectic solvents and uses thereof UNIVERSITY OF OSLO (NO) 2018-10-30 — — US disclosed
US-20180000753-A1 EUTECTIC SOLVENTS AND USES THEREOF UNIVERSITY OF OSLO (NO) 2018-01-04 — — US disclosed
WO-2017218959-A1 PORPHYRIN COMPOUNDS AND COMPOSITIONS USEFUL FOR TREATING CANCER ONCOSELECT THERAPEUTICS, LLC (US) 2017-12-21 — — WO disclosed
WO-2016108083-A1 EUTECTIC SOLVENTS AND USES THEREOF UNIVERSITY OF OSLO (NO) 2016-07-07 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10111842-B2 Eutectic solvents and uses thereof UROD, DUS2, ALAD TOP1 939/4885CYCS 2243/4885STAT3 2370/4885
US-20230302144-A1 Porphyrin Compounds and Compositions Useful for Treating Cancer KIT, HCCS, PPIF TOP1 176/4885CYCS 256/4885STAT3 1427/4885
US-11590233-B2 Porphyrin compounds and compositions useful for treating cancer KIT, HCCS, PPIF TOP1 176/4885CYCS 256/4885STAT3 1427/4885
US-20190184021-A1 Porphyrin Compounds and Compositions Useful for Treating Cancer TK2, KIT, HCCS TOP1 228/4885CYCS 315/4885STAT3 923/4885
US-20180000753-A1 EUTECTIC SOLVENTS AND USES THEREOF UROD, DUS2, ALAD TOP1 939/4885CYCS 2243/4885STAT3 2370/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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